Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 15/20 | 0.60 |
| ▸ | ITK | Q08881 | 7/20 | 0.60 |
| ▸ | BTK | Q06187 | 5/20 | 0.53 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL16370843 | 0.86 | EGFR (0.73) | EGFRITKBTK | |
| SCHEMBL9924738 | 0.84 | BTK (0.69) | EGFRBTK | |
| SCHEMBL28455992 | 0.84 | EGFR (0.66) | EGFRITKBTK | |
| SCHEMBL28446232 | 0.83 | SYK (0.54) | EGFRITK | |
| SCHEMBL15814594 | 0.83 | EGFR (0.74) | EGFRITKBTK | |
| SCHEMBL9945478 | 0.82 | BTK (0.67) | EGFRBTK | |
| SCHEMBL9923766 | 0.81 | BTK (0.74) | EGFRITKBTK | |
| SCHEMBL9945480 | 0.81 | BTK (0.69) | EGFRITKBTK | |
| SCHEMBL28447678 | 0.79 | BTK (0.53) | EGFRITKBTK | |
| SCHEMBL28447680 | 0.79 | BTK (0.55) | EGFRITKBTK |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105384694-B | Substituted aminopyrimidine derivative and preparation method and pharmaceutical application thereof | 四川海思科制药有限公司 | 2020-09-04 | — | — | CN | disclosed |